3,5-difluoro-4-(methylamino)-N-(1-methylcyclopentyl)benzamide

C14H18F2N2O — CID 64688484

IUPAC3,5-difluoro-4-(methylamino)-N-(1-methylcyclopentyl)benzamide
SMILESCNc1c(F)cc(C(=O)NC2(C)CCCC2)cc1F
InChIInChI=1S/C14H18F2N2O/c1-14(5-3-4-6-14)18-13(19)9-7-10(15)12(17-2)11(16)8-9/h7-8,17H,3-6H2,1-2H3,(H,18,19)
InChIKeyGXUOJQJTVMYZCO-UHFFFAOYSA-N
MW268.31 g/mol
LogP3.07
Rot. Bonds3

About 3,5-difluoro-4-(methylamino)-N-(1-methylcyclopentyl)benzamide

3,5-difluoro-4-(methylamino)-N-(1-methylcyclopentyl)benzamide (PubChem CID 64688484) has the molecular formula C14H18F2N2O and a molecular weight of 268.31 g/mol. Its IUPAC name is 3,5-difluoro-4-(methylamino)-N-(1-methylcyclopentyl)benzamide.

Molecular Properties

Compound Name3,5-difluoro-4-(methylamino)-N-(1-methylcyclopentyl)benzamide
PubChem CID64688484
Molecular FormulaC14H18F2N2O
Molecular Weight268.31 g/mol
Exact Mass268.14
IUPAC Name3,5-difluoro-4-(methylamino)-N-(1-methylcyclopentyl)benzamide
SMILESCNc1c(F)cc(C(=O)NC2(C)CCCC2)cc1F
InChIInChI=1S/C14H18F2N2O/c1-14(5-3-4-6-14)18-13(19)9-7-10(15)12(17-2)11(16)8-9/h7-8,17H,3-6H2,1-2H3,(H,18,19)
InChIKeyGXUOJQJTVMYZCO-UHFFFAOYSA-N
XLogP3.07
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.31
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3,4,5-trifluoro-N-(1-methylcyclopropyl)benzamide
CID 115634311
N-(2,2-dimethylcyclohexyl)-3,5-difluoro-4-(methylamino)benzamide
CID 79870125
3,5-dihydroxy-N-(1-methylcyclobutyl)benzamide
CID 104939206
4-(methylamino)-N-(1-methylcyclohexyl)benzamide
CID 62175113
N-cycloheptyl-3,5-difluoro-4-(methylamino)benzamide
CID 63187586
3,5-difluoro-4-(methylamino)-N-(oxolan-2-ylmethyl)benzamide
CID 55160007
3,5-difluoro-4-(methylamino)-N-(oxan-2-ylmethyl)benzamide
CID 63185334
N-(3-ethylpentan-3-yl)-3,5-difluoro-4-(methylamino)benzamide
CID 65042721
N-(3,3-dimethylbutan-2-yl)-3,5-difluoro-4-(methylamino)benzamide
CID 104829894
3,5-difluoro-4-(methylamino)-N-[2-(methylamino)-2-oxoethyl]benzamide
CID 63184958
3-fluoro-4-(3-hydroxyprop-1-ynyl)-N-(1-methylcyclopentyl)benzamide
CID 64686483
3,4-difluoro-5-[(1-methylcyclopentyl)carbamoyl]benzenesulfonyl chloride
CID 65398826

Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-4-(methylamino)-N-(1-methylcyclopentyl)benzamide?
The IUPAC name of 3,5-difluoro-4-(methylamino)-N-(1-methylcyclopentyl)benzamide (CID 64688484) is 3,5-difluoro-4-(methylamino)-N-(1-methylcyclopentyl)benzamide.
What is the SMILES notation for 3,5-difluoro-4-(methylamino)-N-(1-methylcyclopentyl)benzamide?
The canonical SMILES for 3,5-difluoro-4-(methylamino)-N-(1-methylcyclopentyl)benzamide is CNc1c(F)cc(C(=O)NC2(C)CCCC2)cc1F.
What is the InChIKey of 3,5-difluoro-4-(methylamino)-N-(1-methylcyclopentyl)benzamide?
The InChIKey is GXUOJQJTVMYZCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2N2O/c1-14(5-3-4-6-14)18-13(19)9-7-10(15)12(17-2)11(16)8-9/h7-8,17H,3-6H2,1-2H3,(H,18,19).
What are the key properties of 3,5-difluoro-4-(methylamino)-N-(1-methylcyclopentyl)benzamide?
3,5-difluoro-4-(methylamino)-N-(1-methylcyclopentyl)benzamide has a molecular weight of 268.31 g/mol, XLogP of 3.07, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-4-(methylamino)-N-(1-methylcyclopentyl)benzamide is sourced from PubChem (CID 64688484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).